General Information of the Compound
Compound ID |
CP0408702
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Compound Name |
2-(cyclohexanecarbonylamino)-N-[4-(trifluoromethyl)phenyl]benzamide
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Structure |
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Formula |
C21H21F3N2O2
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Molecular Weight |
390.405
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Canonical SMILES |
FC(F)(F)c1ccc(NC(=O)c2ccccc2NC(=O)C2CCCCC2)cc1
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InChI |
InChI=1S/C21H21F3N2O2/c22-21(23,24)15-10-12-16(13-11-15)25-20(28)17-8-4-5-9-18(17)26-19(27)14-6-2-1-3-7-14/h4-5,8-14H,1-3,6-7H2,(H,25,28)(H,26,27)
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InChIKey |
KASDOQIVMVIPKZ-UHFFFAOYSA-N
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Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound